ethyl 2-[(2,5-dinitro-1-benzothiophen-3-yl)amino]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[(2,5-dinitro-1-benzothiophen-3-yl)amino]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[(2,5-dinitrobenzothiophen-3-yl)amino]-2-oxo-acetate CAS Name: 2-[(2,5-dinitro-1-benzothiophen-3-yl)amino]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[(2,5-dinitro-1-benzothiophen-3-yl)amino]-2-oxoacetate Traditional Name: 2-[(2,5-dinitrobenzothiophen-3-yl)amino]-2-keto-acetic acid ethyl ester Formula: C12H9N3O7S MolecularWeight: 339.28076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=C(SC2=C1C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=O)NC1=C(SC2=C1C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O7S/c1-2-22-12(17)10(16)13-9-7-5-6(14(18)19)3-4-8(7)23-11(9)15(20)21/h3-5H,2H2,1H3,(H,13,16)